Products for Research Use Only
RegisterLogin

TMPyP tetrachloride

CAT: 0931-TYD-01297-03Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-TYD-01297-03Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
92739-63-4
Bioactivity
TMPyP tetrachloride is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
Smiles
C[N+](C=C1)=CC=C1C(C2=CC=C(C(C3=CC=[N+](C)C=C3)=C4N=C(C(C5=CC=[N+](C)C=C5)=C6C=CC(N6)=C7C8=CC=[N+](C)C=C8)C=C4)N2)=C9C=CC7=N9.[Cl-].[Cl-].[Cl-].[Cl-]
Molecular Formula
C44H38Cl4N8
Molecular Weight
820.64
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5,10,15,20-Tetrakis(N-methyl-4-pyridyl)-21,23H-porphyrin tetrachloride
CAS Number92739-63-4
PubChem CID135509775
IUPAC Name5,10,15,20-tetrakis(1-methylpyridin-1-ium-4-yl)-21,23-dihydroporphyrin tetrachloride
Molecular FormulaC44H38Cl4N8
Molecular Weight820.6
Topological Polar Surface Area72.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count56
Formal Charge0
Complexity965
SMILES
C[N+]1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=[N+](C=C7)C)C8=CC=[N+](C=C8)C)C=C4)C9=CC=[N+](C=C9)C)N3.[Cl-].[Cl-].[Cl-].[Cl-]
InChI
InChI=1S/C44H37N8.4ClH/c1-49-21-13-29(14-22-49)41-33-5-7-35(45-33)42(30-15-23-50(2)24-16-30)37-9-11-39(47-37)44(32-19-27-52(4)28-20-32)40-12-10-38(48-40)43(36-8-6-34(41)46-36)31-17-25-51(3)26-18-31;;;;/h5-28H,1-4H3,(H,45,46,47,48);4*1H/q+3;;;;/p-3
InChIKey
QAJDBICYDICFCM-UHFFFAOYSA-K
Chemical Structure
2D Structure
2D structure of 5,10,15,20-Tetrakis(N-methyl-4-pyridyl)-21,23H-porphyrin tetrachloride
CAS: 92739-63-4
CID: 135509775
Formula: C44H38Cl4N8
MW: 820.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight820.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass820.194404
Monoisotopic Mass818.197354
Topological Polar Surface Area72.9 Ų
Heavy Atom Count56
Formal Charge0
Complexity965
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count5
Compound Is CanonicalizedYes

Related Products

CatalogName
T27314-01Fe-TMPyP
T35966-01Mn (III) TMPyP
TYD-01277-01Mn (III) TMPyP pentachloride
T13174-01TMPyP4 tosylate

Alternative Products

CatalogName
HY-W112938-01TMPyP (tetrachloride)
GTR19244942-01TMPyP tetrachloride
HY-W112937Zn (II) TMPyP (tetrachloride)
HY-W112545M-TMPyP (tetrachloride)
GTR19245102-01M-TMPyP tetrachloride
GTR19245079-01Zn (II) TMPyP tetrachloride
HY-W112936-01Pd (II) TMPyP (tetrachloride)
GTR19245090-01Pd (II) TMPyP tetrachloride
GTR19197642-01Fe-TMPyP
GTR19191709-01Mn (III) TMPyP

Popular Products